Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Lithium Ion SCHEMBL45641 | 0.95 | — | — | |
| Water SCHEMBL8933649 | 0.95 | — | — | |
| Fluoride Ion SCHEMBL2475572 | 0.90 | — | — | |
| Lithium Ion SCHEMBL5058124 | 0.90 | — | — | |
| Fluoride SCHEMBL10930688 | 0.90 | — | — | |
| Water SCHEMBL8626550 | 0.89 | — | — | |
| Water SCHEMBL299413 | 0.89 | — | — | |
| Water SCHEMBL7772579 | 0.89 | — | — | |
| Water SCHEMBL1109677 | 0.89 | — | — | |
| Water SCHEMBL578147 | 0.89 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2861544-B1 | GROUT FOR TILES COATING | LITOKOL S P A (IT) | 2016-08-10 | — | — | EP | claimed |
| EP-2900462-A1 | MULTILAYERED LAMINATE AND PROCESS FOR PREPARING THE SAME | Valspar Sourcing, Inc. (US) | 2015-08-05 | — | — | EP | claimed |
| EP-2861544-A1 | GROUT FOR TILES COATING | Litokol S.p.A. (IT) | 2015-04-22 | — | — | EP | claimed |
| WO-2013186122-A4 | GROUT FOR TILES COATING | LITOKOL S.P.A. (IT) | 2014-02-06 | — | — | WO | claimed |
| WO-2013186122-A1 | GROUT FOR TILES COATING | LITOKOL S.P.A. (IT) | 2013-12-19 | — | — | WO | claimed |
| US-11540995-B2 | Eye-makeup cosmetic composition | LVMH RECHERCHE (FR) | 2023-01-03 | — | — | US | disclosed |
| CN-111321854-B | Reflective thermal barrier multicolor coating system with crack resistance | 广东华润涂料有限公司 | 2022-04-08 | — | — | CN | disclosed |
| CN-113908079-A | Eye cosmetic composition | LVMH研究公司 | 2022-01-11 | — | — | CN | disclosed |
| CN-111321854-A | Reflective thermal barrier multicolor coating system with crack resistance | 广东华润涂料有限公司 | 2020-06-23 | — | — | CN | disclosed |
| CN-107580556-B | Printable film | 惠普发展公司，有限责任合伙企业 | 2020-06-09 | — | — | CN | disclosed |
| CN-111050745-A | Nucleic acid ligands for consumer product compositions | 宝洁公司 | 2020-04-21 | — | — | CN | disclosed |
| CN-111032870-A | Adapter for oral care applications | 宝洁公司 | 2020-04-17 | — | — | CN | disclosed |
| EP-2861544-B1 | GROUT FOR TILES COATING | LITOKOL S P A (IT) | 2016-08-10 | — | — | EP | disclosed |
| WO-2015154804-A1 | EYE-MAKEUP COSMETIC COMPOSITION | LVMH RECHERCHE (FR) | 2015-10-15 | — | — | WO | disclosed |
| EP-2861544-A1 | GROUT FOR TILES COATING | Litokol S.p.A. (IT) | 2015-04-22 | — | — | EP | disclosed |
| WO-2013186122-A4 | GROUT FOR TILES COATING | LITOKOL S.P.A. (IT) | 2014-02-06 | — | — | WO | disclosed |
| WO-2013186122-A1 | GROUT FOR TILES COATING | LITOKOL S.P.A. (IT) | 2013-12-19 | — | — | WO | disclosed |
| US-20100304970-A1 | HERBICIDAL COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-12-02 | — | — | US | disclosed |
| US-20050101488-A1 | Herbicidal composition | SUMITOMO CHEMICAL COMPANY, LIMITED | 2005-05-12 | — | — | US | disclosed |
| WO-1992004006-A1 | DESENSITIZING DENTAL COMPOSITION | NEIRINCKX RUDI DOMINIQUE (CH) | 1992-03-19 | — | — | WO | disclosed |